[[(2Z)-9-[[2-(dimethylamino)-3-phenyl-propanoyl]amino]-5,8-bis(oxidanylidene)-10-propan-2-yl-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-6-yl]-phenyl-methyl] ethanoate

Systemtic Name: [[(2Z)-9-[[2-(dimethylamino)-3-phenyl-propanoyl]amino]-5,8-bis(oxidanylidene)-10-propan-2-yl-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-6-yl]-phenyl-methyl] ethanoate Openeye Name: [[(2Z)-9-[[2-(dimethylamino)-3-phenyl-propanoyl]amino]-10-isopropyl-5,8-dioxo-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-6-yl]-phenyl-methyl] acetate CAS Name: acetic acid [[(2Z)-9-[[2-(dimethylamino)-1-oxo-3-phenylpropyl]amino]-5,8-dioxo-10-propan-2-yl-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-6-yl]-phenylmethyl] ester IUPAC Name: [[(2Z)-9-[[2-(dimethylamino)-3-phenylpropanoyl]amino]-5,8-dioxo-10-propan-2-yl-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-6-yl]-phenylmethyl] acetate Traditional Name: acetic acid [[(2Z)-9-[[2-(dimethylamino)-3-phenyl-propanoyl]amino]-10-isopropyl-5,8-diketo-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-6-yl]-phenyl-methyl] ester Formula: C36H42N4O6 MolecularWeight: 626.74188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(C(=O)NC(C(=O)NC=CC2=CC=C(O1)C=C2)C(C3=CC=CC=C3)OC(=O)C)NC(=O)C(CC4=CC=CC=C4)N(C)C

Isomeric SMILES

CC(C)C1C(C(=O)NC(C(=O)N/C=C\C2=CC=C(O1)C=C2)C(C3=CC=CC=C3)OC(=O)C)NC(=O)C(CC4=CC=CC=C4)N(C)C

InChI

InChI=1S/C36H42N4O6/c1-23(2)32-30(38-34(42)29(40(4)5)22-26-12-8-6-9-13-26)36(44)39-31(33(45-24(3)41)27-14-10-7-11-15-27)35(43)37-21-20-25-16-18-28(46-32)19-17-25/h6-21,23,29-33H,22H2,1-5H3,(H,37,43)(H,38,42)(H,39,44)/b21-20-